{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-nonorthogonal-periodic-3d-cell-fixed-particles-fixed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "unrelaxed-periodic-cell-vector-1" { "source-unit" "angstrom" "source-value" [ 5.37157 0 0 ] "si-unit" "m" "si-value" [ 5.37157e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.00742946 5.44743 0 ] "si-unit" "m" "si-value" [ -7.42946e-13 5.447429999999999e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0324182 0.1292 5.41398 ] "si-unit" "m" "si-value" [ 3.24182e-12 1.292e-11 5.41398e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0294164 -0.0853048 -0.0527531 ] [ 1.50657 1.46533 1.29324 ] [ 0.0376731 2.77305 2.66982 ] [ 1.30492 4.09759 4.08062 ] [ 2.57907 0.017247 2.67471 ] [ 4.14556 1.36588 4.04305 ] [ 2.78643 2.5664 0.0569683 ] [ 4.11497 4.06206 1.21769 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.94164e-12 -8.530480000000001e-12 -5.27531e-12 ] [ 1.50657e-10 1.46533e-10 1.29324e-10 ] [ 3.76731e-12 2.77305e-10 2.66982e-10 ] [ 1.30492e-10 4.09759e-10 4.08062e-10 ] [ 2.57907e-10 1.7247e-12 2.67471e-10 ] [ 4.14556e-10 1.36588e-10 4.04305e-10 ] [ 2.78643e-10 2.5664e-10 5.69683e-12 ] [ 4.114969999999999e-10 4.06206e-10 1.21769e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.6177983 1.5057746 0.3910029 ] [ -4.8097322 -3.0341634 2.4242134 ] [ 0.5218757 -0.4466884 -0.4653673 ] [ 1.4052703 -0.642158 -0.1060309 ] [ 2.7374351 -0.5088494 0.1953324 ] [ -1.7370081 0.0075441 -0.8460604 ] [ 2.1737396 3.3163576 -4.0537519 ] [ -1.9093786 -0.1978171 2.4606618 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.591998613429985e-09 2.412516860314472e-09 6.264557050450003e-10 ] [ -7.70604048314895e-09 -4.861265663167039e-09 3.88401803331008e-09 ] [ 8.361370455036346e-10 -7.156737112625587e-10 -7.456006081448198e-10 ] [ 2.251491220564603e-09 -1.028850534459686e-09 -1.698802290623827e-10 ] [ 4.385854518177311e-09 -8.152666121881075e-10 3.129570045647539e-10 ] [ -2.782993767960228e-09 1.208698064497728e-11 -1.355538192664696e-09 ] [ 3.482714766827144e-09 5.313390612932399e-09 -6.494826520703579e-09 ] [ -3.059161753175835e-09 -3.169379328144557e-10 3.942414807655646e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.596005 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.70310870048799e-18 } }